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771574-74-4 | Propanedinitrile, [(3,5-dichlorophenyl)methylene]-
CAS No: 771574-74-4 Catalog No: AG005DF8 MDL No:
Product Description
Catalog Number:
AG005DF8
Chemical Name:
Propanedinitrile, [(3,5-dichlorophenyl)methylene]-
CAS Number:
771574-74-4
Molecular Formula:
C10H4Cl2N2
Molecular Weight:
223.0582
IUPAC Name:
2-[(3,5-dichlorophenyl)methylidene]propanedinitrile
InChI:
InChI=1S/C10H4Cl2N2/c11-9-2-7(3-10(12)4-9)1-8(5-13)6-14/h1-4H
InChI Key:
OJKLFRAGLMQDME-UHFFFAOYSA-N
SMILES:
N#CC(=Cc1cc(Cl)cc(c1)Cl)C#N
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.975g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.056g/mol
Monoisotopic Mass:
221.975g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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